2-[[N-(4-methylphenyl)sulfonyl-C-oxidanidyl-carbonimidoyl]-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: 2-[[N-(4-methylphenyl)sulfonyl-C-oxidanidyl-carbonimidoyl]-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: 2-[(2-oxido-2-oxo-ethyl)-[C-oxido-N-(p-tolylsulfonyl)carbonimidoyl]amino]acetate CAS Name: 2-[[(4-methylphenyl)sulfonylimino-oxidomethyl]-(2-oxido-2-oxoethyl)amino]acetate IUPAC Name: 2-[[N-(4-methylphenyl)sulfonyl-C-oxidocarbonimidoyl]-(2-oxido-2-oxoethyl)amino]acetate Traditional Name: 2-[(2-keto-2-oxido-ethyl)-(C-oxido-N-tosyl-carbonimidoyl)amino]acetate Formula: C12H11N2O7S-3 MolecularWeight: 327.28994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(N(CC(=O)[O-])CC(=O)[O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(N(CC(=O)[O-])CC(=O)[O-])[O-]

InChI

InChI=1S/C12H14N2O7S/c1-8-2-4-9(5-3-8)22(20,21)13-12(19)14(6-10(15)16)7-11(17)18/h2-5H,6-7H2,1H3,(H,13,19)(H,15,16)(H,17,18)/p-3